SCHEMBL28619495

SCHEMBL28619495

N#CC(Cl)(Cl)Cc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.47
SLC6A2 P23975 1/20 0.47
HTR2A P28223 1/20 0.47
HRH1 P35367 1/20 0.47
HTR2B P41595 1/20 0.47
CHRNA4 P43681 1/20 0.47
SLC6A3 Q01959 1/20 0.47
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 1/20 0.42
IDO1 P14902 3/20 0.39
MIF P14174 1/20 0.38
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
TAAR1 Q96RJ0 2/20 0.37
AGXT P21549 2/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11566623 0.81 IDO1 (0.38) ALDH1A1KDM4EIDO1MIFMAOA
SCHEMBL11568801 0.81 ESR1 (0.36) IDO1ESR1ESR2CYP1A2CYP3A4
SCHEMBL28655920 0.80 ATM (0.46) SLC6A2ALDH1A1IDO1MAOBESR1
SCHEMBL11825477 0.79 TAAR1 (0.43) SLC6A4SLC6A2HTR2AHRH1HTR2B
SCHEMBL27277537 0.77 SLC6A4 (0.45) SLC6A4SLC6A2HTR2AHRH1HTR2B
SCHEMBL2823833 0.77 SLC6A4 (0.55) SLC6A4SLC6A2HTR2AHRH1HTR2B
SCHEMBL6825275 0.77 SLC6A4 (0.55) SLC6A4SLC6A2HTR2AHRH1HTR2B
SCHEMBL3658885 0.74 SLC6A4 (0.56) SLC6A4SLC6A2HTR2AHRH1HTR2B
SCHEMBL6824263 0.74 SLC6A4 (0.47) SLC6A4SLC6A2HTR2AHRH1HTR2B
SCHEMBL4835685 0.72 SLC6A4 (0.50) SLC6A4SLC6A2HTR2AHRH1HTR2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113387891-A Synthesis process of high-purity oxiconazole nitrate 湖南中威制药有限公司 2021-09-14 CN claimed